Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.6423 -0.7987 -0.4514 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5995 0.1187 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2770 -0.3347 -0.2135 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8428 0.3641 0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6256 1.4183 0.8608 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2008 -0.0497 -0.0896 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2087 0.6669 0.3356 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5478 -1.4956 -0.9994 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.1861 -0.3060 -1.2751 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2014 -1.7624 -0.8345 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3634 -1.0568 0.3532 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7714 1.1431 -0.2415 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6339 0.1462 1.2236 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0038 1.5634 0.8995 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2455 0.3832 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers